CID 165993797

(1s,3r)-3-(tert-butoxy)cyclopentan-1-amine hydrochloride

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)(C)O[C@@H]1CC[C@@H](C1)N
InChI
InChI=1S/C9H19NO/c1-9(2,3)11-8-5-4-7(10)6-8/h7-8H,4-6,10H2,1-3H3/t7-,8+/m0/s1
InChIKey
QPGREGAAYKBEGU-JGVFFNPUSA-N
Compound name
(1S,3R)-3-[(2-methylpropan-2-yl)oxy]cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 137.5
[M+Na]+ 180.13589 143.3
[M-H]- 156.13939 140.3
[M+NH4]+ 175.18049 160.0
[M+K]+ 196.10983 142.5
[M+H-H2O]+ 140.14393 132.7
[M+HCOO]- 202.14487 158.8
[M+CH3COO]- 216.16052 179.1
[M+Na-2H]- 178.12134 140.8
[M]+ 157.14612 134.6
[M]- 157.14722 134.6
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.