CID 165653355

2751614-92-1

Structural Information

Molecular Formula

C₆H₁₀ClNO

SMILES

C1C2(CC1(OC2)CN)Cl

InChI

InChI=1S/C6H10ClNO/c7-5-1-6(2-5,3-8)9-4-5/h1-4,8H2

InChIKey

IZQWICICBZUYFL-UHFFFAOYSA-N

Compound name

(4-chloro-2-oxabicyclo[2.1.1]hexan-1-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 147.04509 Da
Monoisotopic Mass: -0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	148.05237	119.0
[M+Na]+	170.03431	123.3
[M+NH4]+	165.07891	128.5
[M+K]+	186.00825	120.0
[M-H]-	146.03781	116.4
[M+Na-2H]-	168.01976	118.9
[M]+	147.04454	118.1
[M]-	147.04564	118.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.