CID 216695

37613-71-1

Structural Information

Molecular Formula
C11H21N
SMILES
CC1=C(CCC1(C)C)CC(C)N
InChI
InChI=1S/C11H21N/c1-8(12)7-10-5-6-11(3,4)9(10)2/h8H,5-7,12H2,1-4H3
InChIKey
YSPBJVRIKZMUOP-UHFFFAOYSA-N
Compound name
1-(2,3,3-trimethylcyclopenten-1-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.1674 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.17468 139.7
[M+Na]+ 190.15662 146.8
[M-H]- 166.16012 143.1
[M+NH4]+ 185.20122 164.1
[M+K]+ 206.13056 145.1
[M+H-H2O]+ 150.16466 135.4
[M+HCOO]- 212.16560 162.2
[M+CH3COO]- 226.18125 184.7
[M+Na-2H]- 188.14207 141.5
[M]+ 167.16685 138.2
[M]- 167.16795 138.2
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.