CID 130976408

1-(methoxymethyl)cyclohex-3-en-1-amine hydrochloride

Structural Information

Molecular Formula
C8H15NO
SMILES
COCC1(CCC=CC1)N
InChI
InChI=1S/C8H15NO/c1-10-7-8(9)5-3-2-4-6-8/h2-3H,4-7,9H2,1H3
InChIKey
BJRYPSJURUNWQK-UHFFFAOYSA-N
Compound name
1-(methoxymethyl)cyclohex-3-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 130.4
[M+Na]+ 164.104588 136.2
[M-H]- 140.108094 133.2
[M+NH4]+ 159.149193 153.3
[M+K]+ 180.078528 135.4
[M+H-H2O]+ 124.112630 125.4
[M+HCOO]- 186.113571 153.1
[M+CH3COO]- 200.129221 174.7
[M+Na-2H]- 162.090036 137.5
[M]+ 141.11482142 127.1
[M]- 141.11591858 127.1
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

No patent data available for this compound.