CID 208743

32920-66-4

Structural Information

Molecular Formula
C16H23N
SMILES
CCCC12CCN(C1CCC3=CC=CC=C23)C
InChI
InChI=1S/C16H23N/c1-3-10-16-11-12-17(2)15(16)9-8-13-6-4-5-7-14(13)16/h4-7,15H,3,8-12H2,1-2H3
InChIKey
CYQVVPQPSRXGMV-UHFFFAOYSA-N
Compound name
3-methyl-9b-propyl-2,3a,4,5-tetrahydro-1H-benzo[e]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.18304 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.19032 156.6
[M+Na]+ 252.17226 169.0
[M+NH4]+ 247.21686 168.5
[M+K]+ 268.14620 160.0
[M-H]- 228.17576 159.9
[M+Na-2H]- 250.15771 162.3
[M]+ 229.18249 159.5
[M]- 229.18359 159.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.