CID 28064059

956722-42-2

Structural Information

Molecular Formula
C7H15NO
SMILES
COC[C@H]1CCC[C@H]1N
InChI
InChI=1S/C7H15NO/c1-9-5-6-3-2-4-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7-/m1/s1
InChIKey
VZBHNURRLOHCAS-RNFRBKRXSA-N
Compound name
trans-(1R,2S)-2-(methoxymethyl)cyclopentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

129.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 128.2
[M+Na]+ 152.104588 134.3
[M-H]- 128.108094 130.9
[M+NH4]+ 147.149193 151.5
[M+K]+ 168.078528 133.6
[M+H-H2O]+ 112.112630 122.9
[M+HCOO]- 174.113571 151.7
[M+CH3COO]- 188.129221 173.4
[M+Na-2H]- 150.090036 131.7
[M]+ 129.11482142 125.1
[M]- 129.11591858 125.1
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

patents stripe