CID 10797800

(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine

Structural Information

Molecular Formula
C12H17NO
SMILES
COC1=CC2=C(C=C1)C(CCC2)CN
InChI
InChI=1S/C12H17NO/c1-14-11-5-6-12-9(7-11)3-2-4-10(12)8-13/h5-7,10H,2-4,8,13H2,1H3
InChIKey
PWCAWOYQXQCEEV-UHFFFAOYSA-N
Compound name
(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

191.13101 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 141.7
[M+Na]+ 214.12023 148.2
[M-H]- 190.12373 145.4
[M+NH4]+ 209.16483 162.1
[M+K]+ 230.09417 145.3
[M+H-H2O]+ 174.12827 135.6
[M+HCOO]- 236.12921 162.9
[M+CH3COO]- 250.14486 186.9
[M+Na-2H]- 212.10568 147.5
[M]+ 191.13046 139.1
[M]- 191.13156 139.1
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