CID 71523874

Keramamine c

Structural Information

Molecular Formula
C23H33N3
SMILES
C1CCN(CCCC/C=C\C1)CC[C@@H]2C3=C(CCN2)C4=CC=CC=C4N3
InChI
InChI=1S/C23H33N3/c1-2-4-6-10-17-26(16-9-5-3-1)18-14-22-23-20(13-15-24-22)19-11-7-8-12-21(19)25-23/h1-2,7-8,11-12,22,24-25H,3-6,9-10,13-18H2/b2-1-/t22-/m1/s1
InChIKey
DHONBOQKWNCGKC-QWSMJGIRSA-N
Compound name
(1R)-1-[2-[(6Z)-1-azacycloundec-6-en-1-yl]ethyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

351.26746 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.27474 183.7
[M+Na]+ 374.25668 185.7
[M-H]- 350.26018 181.1
[M+NH4]+ 369.30128 191.5
[M+K]+ 390.23062 178.5
[M+H-H2O]+ 334.26472 175.9
[M+HCOO]- 396.26566 191.6
[M+CH3COO]- 410.28131 188.6
[M+Na-2H]- 372.24213 182.9
[M]+ 351.26691 171.2
[M]- 351.26801 171.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.