CID 3068090

Vufb-12268

Structural Information

Molecular Formula
C17H25N
SMILES
CC(C)(CC1=C2CCCC2=CC3=C1CCC3)NC
InChI
InChI=1S/C17H25N/c1-17(2,18-3)11-16-14-8-4-6-12(14)10-13-7-5-9-15(13)16/h10,18H,4-9,11H2,1-3H3
InChIKey
SHYMBVCIXLZRKP-UHFFFAOYSA-N
Compound name
1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-N,2-dimethylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.1987 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.20598 159.1
[M+Na]+ 266.18792 168.5
[M+NH4]+ 261.23252 169.2
[M+K]+ 282.16186 164.8
[M-H]- 242.19142 162.1
[M+Na-2H]- 264.17337 162.4
[M]+ 243.19815 161.2
[M]- 243.19925 161.2
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.