CID 24844839

102206-98-4

Structural Information

Molecular Formula
C15H18N2O
SMILES
CC(C)(CC1=NC=CC2C1NC3=CC=CC=C23)O
InChI
InChI=1S/C15H18N2O/c1-15(2,18)9-13-14-11(7-8-16-13)10-5-3-4-6-12(10)17-14/h3-8,11,14,17-18H,9H2,1-2H3
InChIKey
YLMSOTAROFJYED-UHFFFAOYSA-N
Compound name
1-(9,9a-dihydro-4aH-pyrido[3,4-b]indol-1-yl)-2-methylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.14918 158.5
[M+Na]+ 265.13112 166.5
[M-H]- 241.13462 158.5
[M+NH4]+ 260.17572 176.2
[M+K]+ 281.10506 160.9
[M+H-H2O]+ 225.13916 151.9
[M+HCOO]- 287.14010 173.0
[M+CH3COO]- 301.15575 169.2
[M+Na-2H]- 263.11657 164.4
[M]+ 242.14135 156.5
[M]- 242.14245 156.5
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.