CID 43091234

[(3,4-dihydro-2h-1-benzopyran-3-yl)methyl](methyl)amine hydrochloride

Structural Information

Molecular Formula
C11H15NO
SMILES
CNCC1CC2=CC=CC=C2OC1
InChI
InChI=1S/C11H15NO/c1-12-7-9-6-10-4-2-3-5-11(10)13-8-9/h2-5,9,12H,6-8H2,1H3
InChIKey
IDCJZXTXPUMPQG-UHFFFAOYSA-N
Compound name
1-(3,4-dihydro-2H-chromen-3-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.11537 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.122646 136.9
[M+Na]+ 200.104588 143.0
[M-H]- 176.108094 141.6
[M+NH4]+ 195.149193 156.6
[M+K]+ 216.078528 141.7
[M+H-H2O]+ 160.112630 130.7
[M+HCOO]- 222.113571 158.2
[M+CH3COO]- 236.129221 183.4
[M+Na-2H]- 198.090036 145.9
[M]+ 177.11482142 135.2
[M]- 177.11591858 135.2
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.